libxc12-6.2.2-1.3 RPM for x86_64

From OpenSuSE Tumbleweed for x86_64

Libxc is a library of exchange and correlation functionals. Its
purpose is to be used in codes that implement density-functional
theory. The library includes most of the local density
approximations (LDAs), generalized density approximation (GGAs), and
meta-GGAs. The library provides values for the energy density and its
1st, 2nd, and (for the LDAs) 3rd derivatives.

This package contains the library of libxc.

Provides

• libxc12
• libxc.so.12()(64bit)
• libxc12(x86-64)
• libxcf03.so.12()(64bit)
• libxcf90.so.12()(64bit)

Requires

• /sbin/ldconfig
• /sbin/ldconfig
• libc.so.6()(64bit)
• libc.so.6(GLIBC_2.14)(64bit)
• libc.so.6(GLIBC_2.2.5)(64bit)
• libc.so.6(GLIBC_2.3.4)(64bit)
• libc.so.6(GLIBC_2.4)(64bit)
• libc.so.6(GLIBC_2.7)(64bit)
• libgcc_s.so.1()(64bit)
• libgfortran.so.5()(64bit)
• libgfortran.so.5(GFORTRAN_10)(64bit)
• libgfortran.so.5(GFORTRAN_8)(64bit)
• libm.so.6()(64bit)
• libm.so.6(GLIBC_2.2.5)(64bit)
• libm.so.6(GLIBC_2.29)(64bit)
• libxc.so.12()(64bit)
• rpmlib(CompressedFileNames) <= 3.0.4-1
• rpmlib(FileDigests) <= 4.6.0-1
• rpmlib(PayloadFilesHavePrefix) <= 4.0-1
• rpmlib(PayloadIsZstd) <= 5.4.18-1

License

MPL-2.0

Changelog

* Thu Jun 22 2023 Martin Pluskal <mpluskal@suse.com>
  - Update to version 6.2.2:
    * Dimension of v4rhosigma2lapl, v4rhosigma2tau, v4rhosigmatau2,
      v4sigma3tau arrays was wrong
    * CMake employed ENABLE_XHOST=ON by default, resulting in
      binaries specific to the host processor
* Mon May 29 2023 Dirk Müller <dmueller@suse.com>
  - update to 6.2.0:
    * CMake does not link standard math library in shared xc
      library
    * Taylor expansions used in GGA_C_REVTCA, GGA_K_VT84F,
      MGGA_X_FT98 were not of sufficient to guarantee accuracy of
      all derivatives
    * Replaced hard cutoff in MGGA_X_MBRXC_BG with a Taylor
      expansion
    * StandardMathLibraryC.cmake reusing variable names
    * Memory allocation in xc-regression
    * MGGA_C_REVSCAN was implemented incorrectly
    * Missing comma in MGGA_XC_B97M_V
    * GGA_X_HERMAN was incorrect: the functional is really a meta-
      GGA but its form was unclear and it seems numerically
      unstable
* Wed Dec 14 2022 Atri Bhattacharya <badshah400@gmail.com>
  - Move xc-info binary to devel package and make devel pkg conflict
    with older libxc5 to work around SLPP guideline violation from
    older shared lib versions.
* Fri Dec 09 2022 Atri Bhattacharya <badshah400@gmail.com>
  - Update to version 6.0.0:
    * Changes to the internal handling of derivatives
    * Improvements in array access, resulting in significant
      speedups on GPUs.
    * Bug fix: LDA_C_KARASIEV and LDA_C_KARASIEV_MOD were
      implemented incorrectly.
    * Added:
    - GGA functionals: XC_B97_3C, X_PBE_GAUSSIAN, C_PBE_GAUSSIAN,
      X_PBE_MOD, X_NCAPR
    - HYB_GGA functionals: XC_B3P86_NWCHEM
    - MGGA functionals: C_TPSS_GAUSSIAN, C_CC, C_CCALDA, X_VCML,
      XC_VCML_RVV10
    - HYB_MGGA functionals: XC_BR3P86
    - functions to extract BibTeX reference keys from functionals
  - Specfile clean up.
  - Bump so version.
  - Drop unnecessary autotools BuildRequires (automake, autoconf,
    libtool).
  - Update source URL.
* Tue Jan 01 2019 Jan Engelhardt <jengelh@inai.de>
  - Trim time-sensitive wording from description.
* Sun Dec 30 2018 Christoph Junghans <junghans@votca.org>
  - Update to 4.2.3
    * timeout when generating the xc_func.h file with CMake.
  - Major spec file cleanup
* Sun Jun 17 2018 rwarmbier@uj.ac.za
  - Update to 4.2.1
    * Many changes (see http://www.tddft.org/programs/libxc/changes/) , f.e.:
    * License from LGPL to the Mozilla Public License 2 (MPL2).
    * CPP for Fortran sources macro, so that cpp -C -freestanding is used instead of cpp -ansi.
* Wed Mar 14 2018 robert.warmbier@wits.ac.za
  - Update to 4.0.4
    * Fixed:
    * Incorrect XC_CORRELATION flag in the XC_LDA_K_ZLP, XC_LDA_X_RAE, and XC_GGA_XC_HLE16 functionals.
    * Incorrect XC_EXCHANGE flag in the XC_GGA_C_SG4, XC_GGA_C_PBE_MOL, and XC_GGA_C_TM_PBE functionals.
    * Incorrect XC_EXCHANGE_CORRELATION flag in the XC_MGGA_C_SCAN_RVV10 functional.
    * Incorrect XC_FAMILY_MGGA family in the HYB_MGGA_XC_B0KCIS functional.
* Wed Nov 22 2017 robert.warmbier@wits.ac.za
  - Update to 4.0.3
    * Fixed: Generation of libxc_docs.txt file.
    * Added: Missing C to Fortran interface for xc_f90_nlc_coef.
* Wed Nov 08 2017 robert.warmbier@wits.ac.za
  - Update to 4.0.2
    * See https://gitlab.com/libxc/libxc/wikis/Libxc-changes for details
    * There are a few incompatible changes, be careful

Files

/usr/lib64/libxc.so.12
/usr/lib64/libxc.so.12.2.2
/usr/lib64/libxcf03.so.12
/usr/lib64/libxcf03.so.12.2.2
/usr/lib64/libxcf90.so.12
/usr/lib64/libxcf90.so.12.2.2
/usr/share/licenses/libxc12
/usr/share/licenses/libxc12/COPYING

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Fabrice Bellet, Sat Mar 30 23:52:28 2024